N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester
TL;DR: N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester (CAS 7625-57-2) is a chemical compound with molecular formula C17H24N2O5 and molecular weight 336.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]acetate
Also Known As: methyl N-(tert-butoxycarbonyl)phenylalanylglycinate, Methyl N-(tert-butoxycarbonyl)-D-phenylalanylglycinate, N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester, (S)-Methyl 2-(2-((tert-butoxycarbonyl)amino)-3-phenylpropanamido)acetate, N-((1,1-Dimethylethoxy)carbonyl)-D-phenylalanylglycine methyl ester
| Molecular Formula | C17H24N2O5 |
|---|---|
| Molecular Weight | 336.17 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 93.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 336.16852 |
| Heavy Atoms | 24 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 7625-57-2 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@H](CC1=CC=CC=C1)C(=O)NCC(=O)OC |
| InChIKey | KRYDBLGWCUNDCJ-CYBMUJFWSA-N |
Product Overview
N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester (CAS 7625-57-2), with molecular formula C17H24N2O5 and molecular weight 336.17 g/mol. IUPAC: methyl 2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]acetate.
Chemical Property Profile of N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester
Property Insights of N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester. Following Lipinski's Rule of Five, N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester?
The CAS number of N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester is 7625-57-2.
What is the molecular formula of N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester?
The molecular formula of N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester is C17H24N2O5.
What is the molecular weight of N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester?
The molecular weight of N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester is 336.17 g/mol.
Where can I buy N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester?
You can request a quote for N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-[(1,1-Dimethylethoxy)carbonyl]-D-phenylalanylglycine methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.